Geometry & MOs

Info

ID:	266477
PubChem CID:	103567343
Reduced:	FNSO2C16H16 (1)
Stoich.:	ABCD2E16F16 (1)
Weight, g/mol:	341.004405
ΔH_f, kcal/mol:	-76.33
Dipole, Da:	3.88
IP(EA), eV:	-8.72(-0.79)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-[(2,6-dichlorophenyl)methoxy]-5-methoxybenzenecarbothioamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)F)COC2=CC(=CC(=C2)OC)C(=S)N

DOS

IR

Vibrations